N,N-dimethylethanimidamide hydrochloride

• ChemBase ID: 238837
• Molecular Formular: C4H11ClN2
• Molecular Mass: 122.59654
• Monoisotopic Mass: 122.06107604
• SMILES: C(=N)(N(C)C)C.Cl
• Canonical SMILES: CC(=N)N(C)C.Cl
• InChI: InChI=1S/C4H10N2.ClH/c1-4(5)6(2)3;/h5H,1-3H3;1H
• InChIKey: SKYUGEJKFOMZAH-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N,N-dimethylethanimidamide hydrochloride
• IUPAC Traditional name: N,N-dimethylethanimidamide hydrochloride
• Synonyms: N,N-dimethylethanimidamide hydrochloride

Database IDs

• MDL Number: MFCD22378644
• PubChem SID: 164294747
• PubChem CID: 12287196

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -2.8363311
• LogD (pH = 7.4): -2.836156
• Log P: -0.42087469
• Molar Refractivity: 37.1293 cm^3
• Polarizability: 9.959052 Å^3
• Polar Surface Area: 27.09 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): -1.157

Product Information

• Purity: 95%